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3-(HYDROXYPHENYLMETHYL)-6-METHYL-ISOINDOLIN-1-ONE;ALPHA-(R*)-(3R*)-ISOMER
SpectraBase Compound ID 4pMnfmxKW7o
InChI InChI=1S/C16H15NO2/c1-10-7-8-12-13(9-10)16(19)17-14(12)15(18)11-5-3-2-4-6-11/h2-9,14-15,18H,1H3,(H,17,19)/t14-,15+/m1/s1
InChIKey VXWYZCQYOQQONS-CABCVRRESA-N
Mol Weight 253.3 g/mol
Molecular Formula C16H15NO2
Exact Mass 253.110279 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Folu8EN3zdQ
Name 3-(HYDROXYPHENYLMETHYL)-6-METHYL-ISOINDOLIN-1-ONE;ALPHA-(R*)-(3R*)-ISOMER
Compound Number 39A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H15NO2
InChI InChI=1S/C16H15NO2/c1-10-7-8-12-13(9-10)16(19)17-14(12)15(18)11-5-3-2-4-6-11/h2-9,14-15,18H,1H3,(H,17,19)/t14-,15+/m1/s1
InChIKey VXWYZCQYOQQONS-CABCVRRESA-N
Literature Reference Author K.SMITH,G.A.EL-HITI,A.S.HEGAZY,B.KARIUKI
Literature Reference Citation BEIL.J.ORG.CHEM.,7,1219(2011)
Literature Reference DOI 10.3762/bjoc.7.142
Molecular Weight 253.301 g/mol
Solvent CDCl3
Source File Reference UWBT9638